Vitas-M small molecule compound
(1R,2S)-2-[(2-{4-[(4-ethoxyphenyl)amino]-4-oxobutanoyl}hydrazinyl)carbonyl]cyclohexanecarboxylic acid
Catalog ID
STK078110
SMILES CCOc1ccc(cc1)NC(=O)CCC(=O)NNC(=O)[C@H]1CCCC[C@H]1C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H27N3O6 MW 405.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O6/c1-2-29-14-9-7-13(8-10-14)21-17(24)11-12-18(25)22-23-19(26)15-5-3-4-6-16(15)20(27)28/h7-10,15-16H,2-6,11-12H2,1H3,(H,21,24)(H,22,25)(H,23,26)(H,27,28)/t15-,16+/m0/s1InChIKey
MPXARRVOSXTNAB-JKSUJKDBSA-NSynonyms
(1R2S)2(((4(4ethoxyanilino)4oxobutanoyl)amino)carbamoyl)cyclohexane1carboxylicacid
(1R2S)2((2(4((4ETHOXYPHENYL)AMINO)4OXOBUTANOYL)HYDRAZINYL)CARBONYL)CYCLOHEXANECARBOXYLICACID
CCOC1=CC=C(C=C1)NC(=O)CCC(=O)NNC(=O)C2CCCCC2C(=O)O
CCOc1ccc(cc1)NC(=O)CCC(=O)NNC(=O)(C@H)1CCCC(C@H)1C(=O)O
InChI=1SC20H27N3O6c1229149713(81014)2117(24)111218(25)222319(26)15534616(15)20(27)28h7101516H261112H21H3(H2124)(H2225)(H2326)(H2728)t1516+m0s1
MFCD03371235
STK078110
ZINC000006595743
ZINC6595743
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